2-[(4-tert-butylphenyl)carbonylamino]-5-nitro-benzoic acid

Systemtic Name: 2-[(4-tert-butylphenyl)carbonylamino]-5-nitro-benzoic acid Openeye Name: 2-[(4-tert-butylbenzoyl)amino]-5-nitro-benzoic acid CAS Name: 2-[[(4-tert-butylphenyl)-oxomethyl]amino]-5-nitrobenzoic acid IUPAC Name: 2-[(4-tert-butylbenzoyl)amino]-5-nitrobenzoic acid Traditional Name: 2-[(4-tert-butylbenzoyl)amino]-5-nitro-benzoic acid Formula: C18H18N2O5 MolecularWeight: 342.34592

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])C(=O)O

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C18H18N2O5/c1-18(2,3)12-6-4-11(5-7-12)16(21)19-15-9-8-13(20(24)25)10-14(15)17(22)23/h4-10H,1-3H3,(H,19,21)(H,22,23)